Vitas-M small molecule compound
2-[(3-butyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]-N-(3-methylphenyl)acetamide
Catalog ID
STK546554
SMILES CCCCn1c(SCC(=O)Nc2cccc(c2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C30H35N3O2S MW 501.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H35N3O2S/c1-3-4-17-33-28(35)26-27(24-14-7-6-12-22(24)19-30(26)15-8-5-9-16-30)32-29(33)36-20-25(34)31-23-13-10-11-21(2)18-23/h6-7,10-14,18H,3-5,8-9,15-17,19-20H2,1-2H3,(H,31,34)InChIKey
YEHADQYXCSWDQZ-UHFFFAOYSA-NSynonyms
488825-75-82((3butyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)N(3methylphenyl)acetamide
2((3butyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)N(mtolyl)acetamide
2(3BUTYL4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLN(3METHYLPHENYL)ACETAMIDE
488825758
CCCCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC(=O)NC5=CC=CC(=C5)C
InChI=1SC30H35N3O2Sc134173328(35)2627(2414761222(24)1930(26)158591630)3229(33)362025(34)312313101121(2)1823h67101418H358915171920H212H3(H3134)
MFCD03293953
ZINC000002372557
ZINC02372557
ZINC2372557
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